ethyl 2-[4-(2-fluorophenyl)piperazin-1-yl]-6-oxidanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[4-(2-fluorophenyl)piperazin-1-yl]-6-oxidanylidene-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-[4-(2-fluorophenyl)piperazin-1-yl]-6-oxo-1H-pyrimidine-5-carboxylate CAS Name: 2-[4-(2-fluorophenyl)-1-piperazinyl]-6-oxo-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-(2-fluorophenyl)piperazin-1-yl]-6-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 2-[4-(2-fluorophenyl)piperazino]-6-keto-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C17H19FN4O3 MolecularWeight: 346.356163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(NC1=O)N2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)C1=CN=C(NC1=O)N2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C17H19FN4O3/c1-2-25-16(24)12-11-19-17(20-15(12)23)22-9-7-21(8-10-22)14-6-4-3-5-13(14)18/h3-6,11H,2,7-10H2,1H3,(H,19,20,23)